8018-3238 Screening compound: 2-amino-5-cyano-6-methyl-4-oxo-3-azabicyclo[3.1.0]hex-2-en-1-yl cyanide

8018-3238 Screening compound: 2-amino-5-cyano-6-methyl-4-oxo-3-azabicyclo[3.1.0]hex-2-en-1-yl cyanide
8018-3238 Screening compound: 2-amino-5-cyano-6-methyl-4-oxo-3-azabicyclo[3.1.0]hex-2-en-1-yl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-3238
2-amino-5-cyano-6-methyl-4-oxo-3-azabicyclo[3.1.0]hex-2-en-1-yl cyanide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8018-3238

Molecular Formula

C8H6N4O (C8 H6 N4 O)

Compound Name

2-amino-5-cyano-6-methyl-4-oxo-3-azabicyclo[3.1.0]hex-2-en-1-yl cyanide

IUPAC name

n/a

SMILES

CC(C1(C(N)=NC2=O)C#N)C12C#N

InChI

InChI=1S/C8H6N4O/c1-4-7(2-9)5(11)12-6(13)8(4,7)3-10/h4H,1H3,(H2,11,12,13)

InChI Key

XWOPFTBMDBZBGZ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

174.16

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

-0.584

Distribution Coefficient, logD

-0.584

Water Solubility, LogSw

0.02

Polar Surface Area

78.068

Acid Dissociation Constant (pKa)

13.63

Base Dissociation Constant (pKb)

3.15

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with 8018-3238 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-3238?
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What is the minimum amount of 8018-3238 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-3238
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-3238
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8018-3238 available by request